Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5kcv_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N PHE 21.A O no hydrogen 3.316 N/A LEU 7.A N ARG 19.A O no hydrogen 3.073 N/A HIS 8.A N HIS 76.A O no hydrogen 3.235 N/A LYS 9.A N ARG 17.A O no hydrogen 2.999 N/A ARG 10.A N THR 74.A O no hydrogen 3.339 N/A GLY 11.A N THR 15.A O no hydrogen 2.347 N/A ARG 17.A N LYS 9.A O no hydrogen 3.005 N/A ARG 19.A N LEU 7.A O no hydrogen 2.882 N/A ARG 19.A NE PRO 18.A O no hydrogen 3.293 N/A ARG 19.A NH1 GLU 237.A O no hydrogen 3.340 N/A TYR 20.A N TYR 32.A O no hydrogen 3.006 N/A TYR 20.A OH GLU 4.A OE2 no hydrogen 2.956 N/A PHE 21.A N GLY 5.A O no hydrogen 3.257 N/A LEU 22.A N ILE 30.A O no hydrogen 2.923 N/A LEU 23.A N LYS 3.A O no hydrogen 3.172 N/A LYS 24.A N THR 28.A O no hydrogen 3.021 N/A GLY 27.A N LYS 24.A O no hydrogen 3.400 N/A THR 28.A N ASP 26.A OD1 no hydrogen 3.105 N/A THR 28.A OG1 ASP 26.A OD1 no hydrogen 2.614 N/A THR 28.A OG1 ASP 26.A OD2 no hydrogen 3.213 N/A PHE 29.A N PHE 42.A O no hydrogen 3.020 N/A TYR 32.A N TYR 20.A O no hydrogen 2.920 N/A ASN 40.A N ASN 200.A O no hydrogen 2.733 N/A ASN 41.A ND2 VAL 202.A O no hydrogen 3.028 N/A PHE 42.A N LEU 39.A O no hydrogen 3.297 N/A SER 43.A N ASN 40.A O no hydrogen 3.369 N/A VAL 44.A N GLY 27.A O no hydrogen 3.165 N/A ALA 45.A N SER 43.A OG no hydrogen 2.866 N/A CYS 47.A N VAL 44.A O no hydrogen 3.091 N/A CYS 47.A SG SER 43.A O no hydrogen 3.812 N/A CYS 47.A SG ALA 45.A O no hydrogen 3.432 N/A GLN 48.A N ARG 63.A O no hydrogen 2.756 N/A MET 50.A N ILE 61.A O no hydrogen 3.038 N/A THR 52.A N THR 59.A O no hydrogen 3.139 N/A THR 52.A OG1 ARG 54.A O no hydrogen 3.435 N/A ARG 54.A N THR 52.A OG1 no hydrogen 3.226 N/A ASN 58.A N GLU 53.A OE1 no hydrogen 2.953 N/A THR 59.A OG1 ARG 56.A O no hydrogen 2.396 N/A PHE 60.A N PHE 75.A O no hydrogen 2.791 N/A ILE 61.A N MET 50.A O no hydrogen 3.056 N/A ILE 62.A N ARG 73.A O no hydrogen 2.942 N/A ARG 63.A N GLN 48.A O no hydrogen 3.087 N/A ARG 63.A NE GLU 72.A OE2 no hydrogen 2.772 N/A ARG 63.A NH2 GLU 72.A OE2 no hydrogen 2.550 N/A CYS 64.A N ILE 71.A O no hydrogen 2.766 N/A GLN 66.A N THR 69.A O no hydrogen 2.799 N/A THR 68.A OG1 ASP 223.A OD1 no hydrogen 3.221 N/A THR 68.A OG1 ASP 223.A OD2 no hydrogen 2.677 N/A THR 69.A N GLN 66.A O no hydrogen 3.034 N/A THR 69.A OG1 ASP 223.A OD1 no hydrogen 3.471 N/A ILE 71.A N CYS 64.A O no hydrogen 2.629 N/A ARG 73.A N ILE 62.A O no hydrogen 3.019 N/A ARG 73.A NH1 PHE 29.A O no hydrogen 3.116 N/A ARG 73.A NH1 PHE 42.A O no hydrogen 3.298 N/A ARG 73.A NH2 PHE 29.A O no hydrogen 2.773 N/A PHE 75.A N PHE 60.A O no hydrogen 2.809 N/A HIS 76.A N HIS 8.A O no hydrogen 3.218 N/A VAL 77.A N ASN 58.A O no hydrogen 3.190 N/A GLU 82.A N THR 79.A O no hydrogen 3.173 N/A GLU 82.A N THR 79.A OG1 no hydrogen 3.365 N/A ARG 83.A N THR 79.A O no hydrogen 3.092 N/A ARG 83.A NH1 THR 52.A O no hydrogen 2.601 N/A ARG 83.A NH1 GLU 53.A OE2 no hydrogen 2.729 N/A ARG 83.A NH1 THR 59.A O no hydrogen 2.812 N/A ARG 83.A NH2 GLU 53.A OE2 no hydrogen 2.501 N/A GLU 84.A N PRO 80.A O no hydrogen 2.947 N/A GLU 85.A N GLU 81.A O no hydrogen 2.979 N/A TRP 86.A N GLU 82.A O no hydrogen 3.209 N/A THR 87.A N ARG 83.A O no hydrogen 2.925 N/A THR 87.A OG1 ARG 83.A O no hydrogen 2.747 N/A THR 88.A N GLU 84.A O no hydrogen 3.105 N/A THR 88.A OG1 GLU 84.A O no hydrogen 3.217 N/A ALA 89.A N GLU 85.A O no hydrogen 2.822 N/A ILE 90.A N TRP 86.A O no hydrogen 2.678 N/A GLN 91.A N THR 87.A O no hydrogen 2.856 N/A THR 94.A N GLU 97.A OE2 no hydrogen 3.167 N/A ASN 96.A N THR 94.A OG1 no hydrogen 3.024 N/A GLU 97.A N THR 94.A O no hydrogen 2.968 N/A GLU 99.A N LYS 116.A O no hydrogen 2.823 N/A TYR 100.A OH MET 95.A O no hydrogen 2.730 N/A LEU 101.A N LEU 114.A O no hydrogen 2.980 N/A LEU 104.A N VAL 112.A O no hydrogen 2.985 N/A GLY 105.A N VAL 112.A O no hydrogen 3.320 N/A GLY 107.A N GLY 110.A O no hydrogen 2.990 N/A LYS 111.A N ILE 128.A O no hydrogen 2.911 N/A VAL 112.A N GLY 105.A O no hydrogen 2.772 N/A ILE 113.A N MET 126.A O no hydrogen 2.719 N/A LEU 114.A N LYS 102.A O no hydrogen 2.814 N/A VAL 115.A N TYR 124.A O no hydrogen 2.947 N/A LYS 116.A N GLU 99.A O no hydrogen 3.145 N/A GLU 117.A N ARG 122.A O no hydrogen 2.898 N/A LYS 118.A N GLU 97.A O no hydrogen 2.911 N/A THR 120.A N GLU 117.A O no hydrogen 3.267 N/A THR 120.A OG1 GLU 117.A OE1 no hydrogen 3.116 N/A GLY 121.A N GLU 117.A O no hydrogen 2.799 N/A ARG 122.A N THR 120.A OG1 no hydrogen 2.919 N/A TYR 124.A N VAL 115.A O no hydrogen 2.776 N/A ALA 125.A N MET 158.A O no hydrogen 2.826 N/A MET 126.A N ILE 113.A O no hydrogen 2.894 N/A LYS 127.A N PHE 156.A O no hydrogen 2.755 N/A LYS 127.A NZ THR 68.A O no hydrogen 3.023 N/A LYS 127.A NZ THR 68.A OG1 no hydrogen 2.799 N/A LYS 127.A NZ THR 69.A OG1 no hydrogen 3.147 N/A LYS 127.A NZ ASP 223.A O no hydrogen 2.915 N/A ILE 128.A N LYS 111.A O no hydrogen 2.757 N/A LEU 129.A N LEU 154.A O no hydrogen 2.755 N/A LYS 130.A N PHE 109.A O no hydrogen 2.780 N/A LYS 131.A N ASP 152.A O no hydrogen 3.088 N/A LYS 131.A NZ GLN 149.A OE1 no hydrogen 2.527 N/A LYS 131.A NZ THR 150.A O no hydrogen 3.043 N/A LYS 131.A NZ ARG 153.A O no hydrogen 3.421 N/A ASN 135.A ND2 LEU 144.A O no hydrogen 3.036 N/A ARG 137.A N TYR 194.A OH no hydrogen 3.098 N/A HIS 138.A N SER 136.A O no hydrogen 2.767 N/A HIS 138.A NE2 SER 190.A OG no hydrogen 2.646 N/A PHE 140.A N HIS 138.A ND1 no hydrogen 3.335 N/A THR 142.A OG1 ILE 221.A O no hydrogen 2.718 N/A ALA 143.A N GLU 159.A OE1 no hydrogen 2.767 N/A LEU 144.A N ASN 135.A OD1 no hydrogen 3.203 N/A LYS 145.A N VAL 157.A O no hydrogen 2.751 N/A TYR 146.A N VAL 157.A O no hydrogen 3.233 N/A TYR 146.A OH GLU 117.A OE2 no hydrogen 2.465 N/A PHE 148.A N CYS 155.A O no hydrogen 2.896 N/A THR 150.A N ARG 153.A O no hydrogen 2.924 N/A HIS 151.A N THR 150.A OG1 no hydrogen 2.574 N/A ARG 153.A NE ASP 152.A OD1 no hydrogen 3.037 N/A LEU 154.A N LEU 129.A O no hydrogen 2.781 N/A CYS 155.A N PHE 148.A O no hydrogen 2.786 N/A PHE 156.A N LYS 127.A O no hydrogen 2.863 N/A VAL 157.A N TYR 146.A O no hydrogen 2.693 N/A MET 158.A N ALA 125.A O no hydrogen 2.820 N/A GLU 159.A N ALA 143.A O no hydrogen 3.013 N/A LEU 166.A N LEU 211.A O no hydrogen 2.934 N/A PHE 168.A N GLU 165.A O no hydrogen 2.768 N/A HIS 169.A N GLU 165.A O no hydrogen 3.193 N/A HIS 169.A NE2 GLY 163.A O no hydrogen 2.719 N/A LEU 170.A N LEU 166.A O no hydrogen 3.318 N/A SER 171.A N PHE 167.A O no hydrogen 3.102 N/A SER 171.A OG PHE 167.A O no hydrogen 3.113 N/A ARG 172.A N PHE 168.A O no hydrogen 2.944 N/A GLU 173.A N HIS 169.A O no hydrogen 3.399 N/A ARG 174.A N LEU 170.A O no hydrogen 2.725 N/A VAL 175.A N GLU 173.A O no hydrogen 2.801 N/A PHE 176.A N MET 257.A O no hydrogen 2.825 N/A ARG 180.A N SER 177.A O no hydrogen 3.062 N/A ARG 180.A NE TYR 184.A OH no hydrogen 2.895 N/A ARG 180.A NH1 GLU 173.A OE1 no hydrogen 2.807 N/A ARG 180.A NH2 TYR 184.A OH no hydrogen 3.088 N/A ALA 181.A N SER 177.A O no hydrogen 3.084 N/A ARG 182.A N GLU 178.A O no hydrogen 3.285 N/A ARG 182.A NE PHE 322.A O no hydrogen 2.651 N/A ARG 182.A NH2 PHE 322.A O no hydrogen 2.762 N/A PHE 183.A N ASP 179.A O no hydrogen 3.207 N/A TYR 184.A N ARG 180.A O no hydrogen 3.081 N/A GLY 185.A N ALA 181.A O no hydrogen 2.661 N/A ALA 186.A N ARG 182.A O no hydrogen 2.900 N/A GLU 187.A N PHE 183.A O no hydrogen 3.263 N/A ILE 188.A N TYR 184.A O no hydrogen 2.985 N/A VAL 189.A N GLY 185.A O no hydrogen 2.991 N/A SER 190.A N ALA 186.A O no hydrogen 2.953 N/A SER 190.A OG HIS 138.A NE2 no hydrogen 2.646 N/A ALA 191.A N GLU 187.A O no hydrogen 2.825 N/A LEU 192.A N ILE 188.A O no hydrogen 2.733 N/A ASP 193.A N VAL 189.A O no hydrogen 2.751 N/A TYR 194.A N SER 190.A O no hydrogen 2.938 N/A LEU 195.A N ALA 191.A O no hydrogen 3.108 N/A HIS 196.A N LEU 192.A O no hydrogen 2.881 N/A HIS 196.A ND1 ASP 313.A OD2 no hydrogen 3.005 N/A HIS 196.A NE2 ASP 246.A OD2 no hydrogen 2.690 N/A SER 197.A N ASP 193.A O no hydrogen 3.136 N/A SER 197.A OG ASP 193.A O no hydrogen 3.080 N/A GLU 198.A N TYR 194.A O no hydrogen 2.895 N/A LYS 199.A N LEU 195.A O no hydrogen 3.303 N/A ASN 200.A ND2 HIS 196.A O no hydrogen 3.592 N/A VAL 201.A N LEU 195.A O no hydrogen 3.019 N/A VAL 202.A N ASN 41.A OD1 no hydrogen 3.024 N/A TYR 203.A N ASP 246.A OD2 no hydrogen 2.945 N/A TYR 203.A OH THR 222.A O no hydrogen 2.741 N/A ARG 204.A N ASP 246.A OD1 no hydrogen 2.793 N/A ASN 210.A N LYS 207.A O no hydrogen 2.922 N/A ASN 210.A ND2 ASP 205.A O no hydrogen 2.948 N/A LEU 211.A N LEU 208.A O no hydrogen 2.998 N/A MET 212.A N LYS 220.A O no hydrogen 3.078 N/A LEU 213.A N GLY 164.A O no hydrogen 2.923 N/A ASP 214.A N HIS 218.A O no hydrogen 2.725 N/A GLY 217.A N ASP 214.A O no hydrogen 3.059 N/A HIS 218.A N ASP 214.A OD1 no hydrogen 3.307 N/A HIS 218.A ND1 GLU 187.A OE1 no hydrogen 2.606 N/A ILE 219.A N GLU 187.A OE2 no hydrogen 2.996 N/A LYS 220.A N MET 212.A O no hydrogen 2.948 N/A LYS 220.A NZ PRO 139.A O no hydrogen 3.035 N/A LYS 220.A NZ LEU 141.A O no hydrogen 2.962 N/A LYS 220.A NZ GLU 159.A OE1 no hydrogen 2.699 N/A ILE 221.A N PHE 140.A O no hydrogen 2.740 N/A THR 222.A N ASN 210.A O no hydrogen 3.056 N/A TYR 230.A OH GLU 256.A OE1 no hydrogen 2.871 N/A LEU 231.A N PRO 228.A O no hydrogen 3.047 N/A VAL 235.A N ALA 232.A O no hydrogen 2.908 N/A LEU 236.A N ALA 232.A O no hydrogen 3.124 N/A GLU 237.A N PRO 233.A O no hydrogen 3.027 N/A ASP 238.A N VAL 235.A O no hydrogen 3.077 N/A ASN 239.A N GLU 234.A O no hydrogen 3.110 N/A ARG 243.A NH1 ALA 37.A O no hydrogen 3.198 N/A ARG 243.A NH2 PRO 38.A O no hydrogen 3.460 N/A ARG 243.A NH2 HIS 196.A O no hydrogen 3.503 N/A VAL 245.A N GLY 242.A O no hydrogen 3.030 N/A TRP 247.A NE1 ASP 313.A OD1 no hydrogen 2.881 N/A TRP 248.A N ALA 244.A O no hydrogen 3.033 N/A GLY 249.A N VAL 245.A O no hydrogen 2.982 N/A LEU 250.A N ASP 246.A O no hydrogen 2.918 N/A GLY 251.A N TRP 247.A O no hydrogen 2.994 N/A VAL 252.A N TRP 248.A O no hydrogen 3.113 N/A VAL 253.A N GLY 249.A O no hydrogen 2.935 N/A MET 254.A N LEU 250.A O no hydrogen 2.852 N/A TYR 255.A N GLY 251.A O no hydrogen 2.608 N/A GLU 256.A N VAL 252.A O no hydrogen 3.038 N/A MET 257.A N VAL 253.A O no hydrogen 3.080 N/A MET 258.A N MET 254.A O no hydrogen 3.092 N/A CYS 259.A N TYR 255.A O no hydrogen 2.851 N/A CYS 259.A SG TYR 255.A O no hydrogen 3.355 N/A LEU 272.A N ASP 268.A O no hydrogen 2.868 N/A PHE 273.A N HIS 269.A O no hydrogen 2.796 N/A GLU 274.A N GLU 270.A O no hydrogen 3.041 N/A LEU 275.A N LYS 271.A O no hydrogen 3.016 N/A ILE 276.A N LEU 272.A O no hydrogen 2.959 N/A LEU 277.A N PHE 273.A O no hydrogen 3.176 N/A MET 278.A N LEU 275.A O no hydrogen 3.441 N/A GLU 279.A N LEU 275.A O no hydrogen 3.061 N/A GLY 288.A N GLU 178.A OE2 no hydrogen 2.716 N/A LYS 292.A N GLY 288.A O no hydrogen 2.969 N/A SER 293.A N PRO 289.A O no hydrogen 3.110 N/A LEU 294.A N GLU 290.A O no hydrogen 2.879 N/A LEU 295.A N ALA 291.A O no hydrogen 2.920 N/A SER 296.A N LYS 292.A O no hydrogen 2.881 N/A SER 296.A OG LYS 292.A O no hydrogen 2.857 N/A GLY 297.A N SER 293.A O no hydrogen 3.061 N/A LEU 298.A N LEU 294.A O no hydrogen 2.810 N/A LEU 299.A N LEU 295.A O no hydrogen 2.879 N/A LYS 300.A N GLY 297.A O no hydrogen 3.483 N/A LYS 301.A NZ ILE 276.A O no hydrogen 2.842 N/A LYS 301.A NZ GLU 279.A O no hydrogen 2.951 N/A LYS 304.A N ASP 302.A OD1 no hydrogen 3.364 N/A GLN 305.A N ASP 302.A O no hydrogen 2.958 N/A ARG 306.A N ASP 302.A O no hydrogen 3.018 N/A ARG 306.A N PRO 303.A O no hydrogen 3.231 N/A ARG 306.A NE LYS 300.A O no hydrogen 2.906 N/A ARG 306.A NH1 GLU 234.A OE2 no hydrogen 2.137 N/A ARG 306.A NH1 ALA 244.A O no hydrogen 2.858 N/A ARG 306.A NH2 LYS 300.A O no hydrogen 2.902 N/A LEU 307.A N GLY 297.A O no hydrogen 2.879 N/A GLY 309.A N ARG 306.A O no hydrogen 2.983 N/A ASP 313.A N GLY 310.A O no hydrogen 3.286 N/A LYS 315.A N GLU 312.A O no hydrogen 3.034 N/A GLU 316.A N ASP 313.A O no hydrogen 3.369 N/A ILE 317.A N ALA 314.A O no hydrogen 2.918 N/A MET 318.A N ALA 314.A O no hydrogen 3.085 N/A GLN 319.A N LYS 315.A O no hydrogen 3.245 N/A HIS 320.A N ILE 317.A O no hydrogen 3.063 N/A PHE 323.A N HIS 320.A O no hydrogen 2.873 N/A VAL 331.A N VAL 327.A O no hydrogen 3.073 N/A TYR 332.A N TRP 328.A O no hydrogen 3.018 N/A TYR 332.A OH ARG 137.A O no hydrogen 2.781 N/A GLU 333.A N GLN 329.A O no hydrogen 3.165 N/A LYS 334.A N VAL 331.A O no hydrogen 2.868 N/A LYS 335.A N HIS 330.A O no hydrogen 2.873 N/A LYS 335.A NZ GLU 333.A OE1 no hydrogen 3.175 N/A THR 345.A N ASP 349.A OD2 no hydrogen 3.249 N/A ASP 349.A N SER 346.A O no hydrogen 3.019 N/A ARG 351.A N ASP 349.A OD1 no hydrogen 2.902 N/A